#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dii s SER 2 N 0.00 -0.36 0.02 1.61 0.01 -1.26 -5.18 113.70 108.55 2dii s SER 2 Ca 0.00 -0.31 0.03 0.00 1.31 0.00 0.00 55.95 56.98 2dii s SER 2 Cb 0.00 0.59 -0.02 0.00 0.21 0.00 0.00 66.02 66.80 2dii s SER 2 CO 0.00 -1.03 -0.09 -0.94 0.41 0.00 0.00 173.24 171.59 2dii s SER 3 N -2.83 0.99 -0.55 2.44 1.04 -1.26 -5.07 113.70 108.47 2dii s SER 3 Ca 0.06 -0.36 0.04 0.00 0.48 0.00 0.00 55.95 56.17 2dii s SER 3 Cb -0.01 -0.04 0.38 0.00 0.10 0.00 0.00 66.02 66.45 2dii s SER 3 CO -0.06 -0.04 1.14 0.61 0.98 0.00 0.00 173.24 175.86 2dii n GLY 4 N 2.11 5.84 3.44 7.32 0.00 -1.26 -4.99 105.19 117.64 2dii n GLY 4 Ca -0.18 -2.75 -0.44 0.00 0.00 0.00 0.00 46.02 42.65 2dii n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dii s SER 5 N -3.26 6.44 0.74 1.61 0.01 -1.26 -5.03 113.70 112.96 2dii s SER 5 Ca 0.48 -1.68 -0.15 0.00 1.31 0.00 0.00 55.95 55.91 2dii s SER 5 Cb 0.35 -2.38 0.04 0.00 0.21 0.00 0.00 66.02 64.24 2dii s SER 5 CO -0.18 -1.16 1.24 -1.20 0.41 0.00 0.00 173.24 172.34 2dii n SER 6 N 6.76 1.45 -3.65 2.44 7.64 -1.26 -5.03 113.62 121.97 2dii n SER 6 Ca 0.11 0.69 -0.02 0.00 1.01 0.00 0.00 58.87 60.66 2dii n SER 6 Cb 0.47 -1.53 -0.06 0.00 -1.01 0.00 0.00 64.21 62.08 2dii n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dii s GLY 7 N -1.81 0.34 0.52 0.23 0.00 -1.26 -5.15 107.32 100.18 2dii s GLY 7 Ca 0.77 3.44 -0.21 0.00 0.00 0.00 0.00 44.72 48.72 2dii s GLY 7 CO 0.46 1.72 0.97 1.97 0.00 0.00 0.00 173.10 178.22 2dii n PHE 8 N 1.22 0.93 -2.61 1.90 1.16 -1.26 -5.00 117.46 113.81 2dii n PHE 8 Ca -0.07 0.49 -0.22 0.00 -1.87 0.00 0.00 57.45 55.78 2dii n PHE 8 Cb 0.58 -2.18 0.05 0.00 -1.61 0.00 0.00 39.48 36.31 2dii n PHE 8 CO 0.00 0.00 0.00 -1.59 -1.87 0.00 0.00 176.76 173.30 2dii s LYS 9 N -2.38 2.44 0.19 3.97 -2.85 -1.26 -5.11 119.74 114.75 2dii s LYS 9 Ca 0.69 -0.78 0.04 0.00 -1.00 0.00 0.00 55.97 54.92 2dii s LYS 9 Cb -0.48 -2.45 -0.03 0.00 -2.06 0.00 0.00 37.83 32.80 2dii s LYS 9 CO 0.52 -0.82 0.27 1.03 0.10 0.00 0.00 175.35 176.45 2dii s ARG 10 N -4.83 3.27 -1.03 1.78 1.81 -1.26 -5.05 118.95 113.64 2dii s ARG 10 Ca 0.58 -0.76 -0.15 0.00 -1.72 0.00 0.00 55.73 53.68 2dii s ARG 10 Cb -0.10 -2.83 0.17 0.00 -0.45 0.00 0.00 34.95 31.74 2dii s ARG 10 CO 0.39 0.47 1.19 0.15 -0.68 0.00 0.00 175.30 176.82 2dii s LYS 11 N -3.52 3.83 0.02 3.54 3.01 -1.26 -4.93 119.74 120.43 2dii s LYS 11 Ca 0.33 -2.27 -0.29 0.00 -1.01 0.00 0.00 55.97 52.73 2dii s LYS 11 Cb -0.10 -4.88 0.11 0.00 -1.01 0.00 0.00 37.83 31.95 2dii s LYS 11 CO 0.27 -1.66 1.23 0.00 0.51 0.00 0.00 175.35 175.70 2dii s ALA 12 N 1.62 -2.14 -0.70 5.17 0.00 -1.26 -5.10 121.76 119.35 2dii s ALA 12 Ca 0.34 0.55 0.05 0.00 0.00 0.00 0.00 51.96 52.90 2dii s ALA 12 Cb -0.05 0.44 0.17 0.00 0.00 0.00 0.00 23.12 23.67 2dii s ALA 12 CO -0.06 -1.06 0.49 -0.80 0.00 0.00 0.00 175.76 174.33 2dii s ASN 13 N -3.02 4.69 -0.12 0.00 -0.87 -1.26 -4.89 114.94 109.46 2dii s ASN 13 Ca 0.15 -3.84 -0.19 0.00 -1.57 0.00 0.00 52.86 47.41 2dii s ASN 13 Cb 0.03 -1.58 -0.26 0.00 -0.02 0.00 0.00 41.25 39.42 2dii s ASN 13 CO -0.03 -0.08 0.56 0.50 -2.57 0.00 0.00 177.10 175.48 2dii h LYS 14 N 5.38 0.18 -0.95 -0.60 3.64 -1.99 -3.32 116.57 118.92 2dii h LYS 14 Ca 0.16 -0.31 0.30 0.00 -1.27 0.00 0.00 60.65 59.53 2dii h LYS 14 Cb 0.76 0.12 -0.16 0.00 -0.41 0.00 0.00 32.23 32.53 2dii h LYS 14 CO 0.70 1.15 0.32 1.49 -2.27 0.00 0.00 179.45 180.84 2dii h GLU 15 N -0.50 0.14 -0.11 1.90 4.81 -2.00 1.37 114.58 120.19 2dii h GLU 15 Ca -0.26 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 58.87 2dii h GLU 15 Cb 1.58 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.92 2dii h GLU 15 CO 0.02 0.09 -0.37 -0.07 -0.73 0.00 0.00 179.01 177.96 2dii h LEU 16 N 0.15 0.24 -0.02 1.64 4.07 -1.98 -2.27 115.31 117.13 2dii h LEU 16 Ca 0.66 -0.09 -0.02 0.00 0.08 0.00 0.00 57.88 58.52 2dii h LEU 16 Cb 1.49 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 43.16 2dii h LEU 16 CO -0.73 0.59 -0.05 -0.08 -1.08 0.00 0.00 178.44 177.09 2dii h GLU 17 N 0.20 0.07 -0.42 1.13 4.81 0.16 0.14 114.58 120.67 2dii h GLU 17 Ca 0.02 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 2dii h GLU 17 Cb 0.74 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.09 2dii h GLU 17 CO 0.06 0.64 0.21 1.05 -0.73 0.00 0.00 179.01 180.23 2dii h GLU 18 N -0.48 0.40 -0.16 1.92 4.11 -0.79 -1.49 114.58 118.09 2dii h GLU 18 Ca 0.00 -0.02 -0.08 0.00 0.07 0.00 0.00 59.36 59.32 2dii h GLU 18 Cb 0.64 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2dii h GLU 18 CO 0.01 0.27 -0.23 1.57 0.07 0.00 0.00 179.01 180.70 2dii h LYS 19 N 0.42 0.44 -0.93 1.06 2.10 -1.47 -2.97 116.57 115.21 2dii h LYS 19 Ca 0.18 -0.26 0.19 0.00 -2.00 0.00 0.00 60.65 58.76 2dii h LYS 19 Cb 0.09 0.02 -0.08 0.00 -0.90 0.00 0.00 32.23 31.36 2dii h LYS 19 CO -0.13 0.84 0.60 -0.91 -2.00 0.00 0.00 179.45 177.86 2dii h ASN 20 N 0.06 0.56 1.15 7.07 4.21 -0.48 0.51 115.58 128.67 2dii h ASN 20 Ca 0.02 0.06 -0.06 0.00 1.21 0.00 0.00 56.30 57.53 2dii h ASN 20 Cb 0.80 -0.05 -0.01 0.00 -1.12 0.00 0.00 38.32 37.94 2dii h ASN 20 CO 0.05 0.23 -0.27 -0.09 -1.29 0.00 0.00 177.43 176.06 2dii h ARG 21 N 0.57 0.00 0.10 0.81 2.43 -1.21 -2.12 114.38 114.95 2dii h ARG 21 Ca 0.50 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.51 2dii h ARG 21 Cb 1.01 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.57 2dii h ARG 21 CO -0.24 0.27 -0.74 0.52 -1.51 0.00 0.00 179.97 178.27 2dii h MET 22 N 0.00 0.20 -0.50 0.20 2.86 0.06 -3.11 114.93 114.64 2dii h MET 22 Ca -0.00 -0.34 -0.09 0.00 -2.06 0.00 0.00 59.70 57.20 2dii h MET 22 Cb 0.92 0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.69 2dii h MET 22 CO 0.04 1.17 -0.06 -0.07 1.06 0.00 0.00 176.91 179.05 2dii h LEU 23 N -0.55 0.85 -0.87 1.22 3.38 -0.89 0.46 115.31 118.92 2dii h LEU 23 Ca -0.15 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.54 2dii h LEU 23 Cb 1.49 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 2dii h LEU 23 CO 0.08 0.95 0.29 0.06 0.09 0.00 0.00 178.44 179.91 2dii h GLN 24 N 0.79 1.12 0.10 1.13 3.07 -1.51 -2.97 115.11 116.85 2dii h GLN 24 Ca 0.14 -0.20 -0.29 0.00 0.09 0.00 0.00 58.65 58.39 2dii h GLN 24 Cb 0.55 -0.18 -0.01 0.00 0.08 0.00 0.00 27.48 27.92 2dii h GLN 24 CO 0.03 0.92 -1.40 0.93 0.09 0.00 0.00 178.83 179.39 2dii h GLU 25 N 1.10 0.22 -3.52 0.06 5.08 -1.43 -3.40 114.58 112.69 2dii h GLU 25 Ca 0.25 -0.37 -0.74 0.00 -1.00 0.00 0.00 59.36 57.50 2dii h GLU 25 Cb 0.22 0.14 -0.32 0.00 0.50 0.00 0.00 28.75 29.28 2dii h GLU 25 CO -0.02 1.10 -0.02 0.34 -1.00 0.00 0.00 179.01 179.41 2dii s ASP 26 N -6.95 6.21 0.48 1.42 -1.08 0.16 -4.88 116.67 112.02 2dii s ASP 26 Ca -0.06 -3.30 0.31 0.00 -0.52 0.00 0.00 52.55 48.98 2dii s ASP 26 Cb 0.07 -2.01 1.30 0.00 -1.46 0.00 0.00 42.92 40.83 2dii s ASP 26 CO 0.86 -0.32 1.93 1.55 0.52 0.00 0.00 175.17 179.70 2dii h PRO 27 N 6.71 0.00 -0.02 4.34 0.13 -1.78 -3.13 132.00 138.26 2dii h PRO 27 Ca 0.11 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.20 2dii h PRO 27 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2dii h PRO 27 CO 0.83 0.00 -0.17 0.28 -0.23 0.00 0.00 178.00 178.71 2dii h VAL 28 N 0.00 1.51 -0.23 1.56 2.07 -1.89 -3.32 116.25 115.94 2dii h VAL 28 Ca 0.00 -1.73 0.04 0.00 0.82 0.00 0.00 66.70 65.83 2dii h VAL 28 Cb 0.45 2.57 -0.04 0.00 -1.52 0.00 0.00 31.29 32.76 2dii h VAL 28 CO 0.00 0.47 -0.02 0.25 0.02 0.00 0.00 177.57 178.29 2dii h LEU 29 N -0.47 -0.14 -0.72 2.57 5.85 -1.92 -2.72 115.31 117.77 2dii h LEU 29 Ca -0.01 0.06 0.12 0.00 0.84 0.00 0.00 57.88 58.88 2dii h LEU 29 Cb 0.86 0.11 -0.12 0.00 0.37 0.00 0.00 40.66 41.88 2dii h LEU 29 CO 0.03 -0.04 -0.27 0.33 -0.34 0.00 0.00 178.44 178.16 2dii n PHE 30 N -5.17 0.06 -0.30 1.25 7.35 -1.21 0.18 117.46 119.60 2dii n PHE 30 Ca -0.02 0.88 0.13 0.00 -0.76 0.00 0.00 57.45 57.68 2dii n PHE 30 Cb 0.13 -0.79 0.28 0.00 0.35 0.00 0.00 39.48 39.45 2dii n PHE 30 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 2dii h GLN 31 N 0.00 0.12 0.90 -4.13 -0.00 -1.62 -0.91 115.11 109.48 2dii h GLN 31 Ca 0.26 -0.01 -0.04 0.00 -0.00 0.00 0.00 58.65 58.86 2dii h GLN 31 Cb 0.44 -0.03 0.01 0.00 0.00 0.00 0.00 27.48 27.90 2dii h GLN 31 CO -0.72 0.08 -0.43 -0.07 0.00 0.00 0.00 178.83 177.69 2dii h LEU 32 N 0.13 -1.02 -1.34 -2.39 4.07 0.18 0.65 115.31 115.59 2dii h LEU 32 Ca 0.55 0.03 0.42 0.00 0.08 0.00 0.00 57.88 58.96 2dii h LEU 32 Cb 1.12 0.26 -0.13 0.00 1.08 0.00 0.00 40.66 42.99 2dii h LEU 32 CO -0.73 -0.71 0.80 0.22 -1.08 0.00 0.00 178.44 176.93 2dii h TYR 33 N -1.25 0.58 0.12 1.13 5.03 -0.93 0.27 116.97 121.93 2dii h TYR 33 Ca -0.12 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.21 2dii h TYR 33 Cb 0.93 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 39.06 2dii h TYR 33 CO -0.01 -0.22 -0.06 0.87 -1.32 0.00 0.00 178.16 177.43 2dii h LYS 34 N 0.11 -0.15 -0.15 1.82 1.57 -1.03 0.56 116.57 119.30 2dii h LYS 34 Ca 0.81 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.64 2dii h LYS 34 Cb 2.43 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 34.77 2dii h LYS 34 CO -0.46 -0.10 0.72 0.22 -0.57 0.00 0.00 179.45 179.26 2dii h ASP 35 N -1.03 0.00 0.00 0.86 3.58 0.54 0.68 116.42 121.04 2dii h ASP 35 Ca -0.02 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.43 2dii h ASP 35 Cb 0.12 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2dii h ASP 35 CO 0.03 0.00 -0.75 0.18 -2.88 0.00 0.00 179.24 175.81 2dii n LEU 36 N -2.84 1.68 0.26 2.28 4.77 -0.05 -4.15 117.00 118.95 2dii n LEU 36 Ca 0.02 0.28 -0.15 0.00 -0.03 0.00 0.00 56.01 56.13 2dii n LEU 36 Cb 0.79 -0.64 -0.08 0.00 -2.33 0.00 0.00 43.42 41.15 2dii n LEU 36 CO 0.10 -0.38 0.58 0.58 -1.33 0.00 0.00 177.39 176.94 2dii h VAL 37 N -0.75 0.46 0.00 4.08 2.07 0.65 -2.28 116.25 120.48 2dii h VAL 37 Ca 0.00 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.24 2dii h VAL 37 Cb 0.75 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 2dii h VAL 37 CO 0.00 0.05 0.01 0.58 0.02 0.00 0.00 177.57 178.22 2dii h VAL 38 N -0.85 0.00 -0.03 2.57 2.07 0.28 0.20 116.25 120.50 2dii h VAL 38 Ca -0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 2dii h VAL 38 Cb 0.58 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2dii h VAL 38 CO 0.11 0.00 0.00 -0.24 0.02 0.00 0.00 177.57 177.46 2dii n SER 39 N -2.93 0.92 -2.03 0.57 2.88 -0.99 -4.89 113.62 107.14 2dii n SER 39 Ca -0.03 -1.35 -0.21 0.00 -1.33 0.00 0.00 58.87 55.95 2dii n SER 39 Cb 0.07 -0.01 -0.05 0.00 -0.75 0.00 0.00 64.21 63.47 2dii n SER 39 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dii n GLN 40 N -0.27 -1.58 0.05 -1.46 1.13 0.71 -4.86 117.38 111.11 2dii n GLN 40 Ca 0.20 1.12 -0.22 0.00 -1.94 0.00 0.00 57.00 56.16 2dii n GLN 40 Cb 0.25 -5.66 -0.15 0.00 0.11 0.00 0.00 30.24 24.80 2dii n GLN 40 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2dii h VAL 41 N 0.00 0.85 -4.74 5.09 2.07 -1.60 -3.49 116.25 114.43 2dii h VAL 41 Ca -0.47 -2.48 -0.37 0.00 0.82 0.00 0.00 66.70 64.21 2dii h VAL 41 Cb 1.37 2.69 -0.14 0.00 -1.52 0.00 0.00 31.29 33.69 2dii h VAL 41 CO 0.61 0.87 -0.53 0.27 0.02 0.00 0.00 177.57 178.81 2dii s ILE 42 N -2.57 0.00 0.06 4.57 -4.36 -1.23 -5.05 121.20 112.61 2dii s ILE 42 Ca -0.17 -1.98 0.00 0.00 -0.26 0.00 0.00 60.65 58.24 2dii s ILE 42 Cb 0.06 -2.50 -0.04 0.00 1.25 0.00 0.00 42.46 41.23 2dii s ILE 42 CO 0.83 0.00 0.21 -0.44 0.24 0.00 0.00 174.94 175.78 2dii s SER 43 N -3.28 6.35 0.46 4.36 0.01 -1.26 -4.47 113.70 115.87 2dii s SER 43 Ca 0.40 0.27 0.31 0.00 1.31 0.00 0.00 55.95 58.23 2dii s SER 43 Cb 0.04 -1.96 1.42 0.00 0.21 0.00 0.00 66.02 65.73 2dii s SER 43 CO 0.21 0.17 1.66 0.00 0.41 0.00 0.00 173.24 175.69 2dii h ALA 44 N 3.09 2.82 -0.57 1.44 0.00 -1.96 0.84 119.26 124.92 2dii h ALA 44 Ca -0.45 0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 2dii h ALA 44 Cb 1.16 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 2dii h ALA 44 CO 0.76 -1.37 0.06 0.93 0.00 0.00 0.00 179.25 179.63 2dii h GLU 45 N 0.12 0.97 0.41 0.00 5.08 -1.98 -2.83 114.58 116.34 2dii h GLU 45 Ca 0.77 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.84 2dii h GLU 45 Cb 2.49 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 31.62 2dii h GLU 45 CO -0.31 0.94 -0.35 0.93 -1.00 0.00 0.00 179.01 179.23 2dii h GLU 46 N 0.87 -0.73 -0.04 2.33 4.39 0.34 0.54 114.58 122.28 2dii h GLU 46 Ca 0.17 0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.94 2dii h GLU 46 Cb 0.46 0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 29.23 2dii h GLU 46 CO 0.02 -0.49 -0.48 0.35 -1.16 0.00 0.00 179.01 177.25 2dii h PHE 47 N -0.76 -1.40 0.00 4.33 3.57 -1.50 0.58 116.94 121.76 2dii h PHE 47 Ca -0.04 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2dii h PHE 47 Cb 0.66 0.62 -0.00 0.00 2.79 0.00 0.00 35.95 40.02 2dii h PHE 47 CO -0.17 -0.50 -0.03 -1.49 -2.23 0.00 0.00 178.31 173.89 2dii h TRP 48 N -0.57 0.00 -1.44 0.41 -0.00 -1.44 -2.65 115.95 110.26 2dii h TRP 48 Ca 0.02 0.00 0.43 0.00 -0.00 0.00 0.00 58.89 59.33 2dii h TRP 48 Cb 0.63 0.00 -0.09 0.00 -0.00 0.00 0.00 29.16 29.70 2dii h TRP 48 CO -0.52 0.03 1.00 0.00 -0.00 0.00 0.00 178.44 178.95 2dii h ALA 49 N 1.97 3.12 0.00 1.49 0.00 0.25 0.30 119.26 126.39 2dii h ALA 49 Ca -0.00 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 2dii h ALA 49 Cb 0.10 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2dii h ALA 49 CO 0.00 -1.62 -1.25 0.27 0.00 0.00 0.00 179.25 176.65 2dii n ASN 50 N -4.32 1.93 0.05 0.00 0.23 -1.00 -4.66 115.26 107.49 2dii n ASN 50 Ca 0.35 0.36 -0.15 0.00 -0.53 0.00 0.00 54.58 54.61 2dii n ASN 50 Cb 1.48 -0.77 -0.09 0.00 -2.08 0.00 0.00 39.78 38.32 2dii n ASN 50 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 2dii h ARG 51 N -1.00 -0.61 -7.42 -3.83 -0.00 -1.49 -3.43 114.38 96.61 2dii h ARG 51 Ca -0.14 0.04 -0.48 0.00 -0.50 0.00 0.00 59.98 58.90 2dii h ARG 51 Cb 1.08 0.14 0.08 0.00 0.00 0.00 0.00 29.97 31.27 2dii h ARG 51 CO -0.08 -0.41 0.35 -0.51 0.00 0.00 0.00 179.97 179.32 2dii s LEU 52 N -9.92 2.87 -0.59 3.04 1.43 0.10 -4.37 118.68 111.23 2dii s LEU 52 Ca -0.15 0.91 -0.03 0.00 -1.03 0.00 0.00 54.13 53.83 2dii s LEU 52 Cb 0.06 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.66 2dii s LEU 52 CO 0.57 -1.44 0.51 -3.20 0.23 0.00 0.00 176.35 173.02 2dii n ASN 53 N -2.99 -3.32 -2.38 2.29 2.85 -1.26 -4.63 115.26 105.82 2dii n ASN 53 Ca 0.07 -0.26 -0.35 0.00 -0.11 0.00 0.00 54.58 53.93 2dii n ASN 53 Cb 0.58 -2.56 0.07 0.00 1.24 0.00 0.00 39.78 39.12 2dii n ASN 53 CO 0.00 0.00 0.00 1.33 -2.11 0.00 0.00 177.26 176.48 2dii n VAL 54 N -3.22 3.56 -4.52 3.44 0.24 -1.26 -4.88 118.33 111.68 2dii n VAL 54 Ca -0.04 -3.17 -0.42 0.00 -2.04 0.00 0.00 64.34 58.67 2dii n VAL 54 Cb 0.54 -1.17 -0.08 0.00 -1.47 0.00 0.00 33.84 31.67 2dii n VAL 54 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2dii n ASN 55 N -0.86 -1.71 -3.67 -1.34 2.85 -1.26 -4.88 115.26 104.39 2dii n ASN 55 Ca 0.61 -1.24 -0.15 0.00 -0.11 0.00 0.00 54.58 53.69 2dii n ASN 55 Cb 0.63 -1.64 -0.08 0.00 1.24 0.00 0.00 39.78 39.93 2dii n ASN 55 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2dii s SER 56 N -3.32 -0.46 0.00 1.20 0.15 -1.26 -5.08 113.70 104.92 2dii s SER 56 Ca 0.78 0.63 0.00 0.00 0.70 0.00 0.00 55.95 58.07 2dii s SER 56 Cb -0.46 0.66 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 2dii s SER 56 CO 1.02 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 175.68 2dii n GLY 57 N 1.75 1.06 0.21 9.45 0.00 -1.26 -4.87 105.19 111.53 2dii n GLY 57 Ca -0.18 -0.60 -0.13 0.00 0.00 0.00 0.00 46.02 45.11 2dii n GLY 57 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dii h PRO 58 N 0.00 0.71 -5.79 1.61 0.13 -2.04 -3.48 132.00 123.15 2dii h PRO 58 Ca 0.00 -0.37 -0.37 0.00 -0.87 0.00 0.00 66.00 64.39 2dii h PRO 58 Cb 0.00 0.01 0.14 0.00 0.13 0.00 0.00 31.00 31.28 2dii h PRO 58 CO 0.00 0.99 -0.75 0.43 -0.23 0.00 0.00 178.00 178.44 2dii n SER 59 N -4.26 -3.48 -4.88 1.44 7.64 -1.26 -5.01 113.62 103.82 2dii n SER 59 Ca -0.04 -0.62 -0.22 0.00 1.01 0.00 0.00 58.87 59.00 2dii n SER 59 Cb 0.47 -4.93 -0.02 0.00 -1.01 0.00 0.00 64.21 58.71 2dii n SER 59 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dii s SER 60 N -3.98 4.95 0.00 6.43 0.15 -1.26 -5.26 113.70 114.73 2dii s SER 60 Ca 0.22 -0.85 0.00 0.00 0.70 0.00 0.00 55.95 56.02 2dii s SER 60 Cb -0.10 -0.36 0.00 0.00 -1.71 0.00 0.00 66.02 63.85 2dii s SER 60 CO 0.74 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 175.04